Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8dkn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N PRO 1.A O no hydrogen 3.327 N/A LEU 6.A N GLU 2.A O no hydrogen 3.113 N/A ARG 7.A N SER 3.A O no hydrogen 2.943 N/A ALA 8.A N ALA 4.A O no hydrogen 2.992 N/A LEU 9.A N ASP 5.A O no hydrogen 3.096 N/A ALA 10.A N LEU 6.A O no hydrogen 3.054 N/A LYS 11.A N ARG 7.A O no hydrogen 3.072 N/A LYS 11.A NZ ASP 15.A OD1 no hydrogen 3.098 N/A HIS 12.A N ALA 8.A O no hydrogen 2.978 N/A HIS 12.A NE2 SER 90.A O no hydrogen 3.038 N/A LEU 13.A N LEU 9.A O no hydrogen 2.949 N/A TYR 14.A N ALA 10.A O no hydrogen 3.085 N/A TYR 14.A N LYS 11.A O no hydrogen 3.183 N/A ASP 15.A N LYS 11.A O no hydrogen 3.010 N/A SER 16.A N HIS 12.A O no hydrogen 3.166 N/A SER 16.A OG SER 90.A OG no hydrogen 2.272 N/A TYR 17.A N LEU 13.A O no hydrogen 2.995 N/A TYR 17.A OH ASP 169.A OD1 no hydrogen 2.800 N/A ILE 18.A N TYR 14.A O no hydrogen 2.856 N/A LYS 19.A N ASP 15.A O no hydrogen 3.100 N/A SER 20.A N SER 16.A O no hydrogen 2.931 N/A SER 20.A N TYR 17.A O no hydrogen 3.241 N/A SER 20.A OG SER 16.A O no hydrogen 2.703 N/A PHE 21.A N TYR 17.A O no hydrogen 3.018 N/A LYS 25.A N ASP 169.A OD1 no hydrogen 2.865 N/A LYS 25.A NZ LEU 167.A O no hydrogen 2.907 N/A ALA 26.A N ASP 169.A OD2 no hydrogen 2.809 N/A LYS 27.A N THR 24.A OG1 no hydrogen 3.272 N/A ALA 28.A N THR 24.A O no hydrogen 3.166 N/A ARG 29.A N LYS 25.A O no hydrogen 3.029 N/A ALA 30.A N ALA 26.A O no hydrogen 3.012 N/A ILE 31.A N LYS 27.A O no hydrogen 3.109 N/A LEU 32.A N ALA 28.A O no hydrogen 3.038 N/A THR 33.A N ARG 29.A O no hydrogen 2.770 N/A THR 33.A OG1 ARG 29.A O no hydrogen 2.898 N/A THR 33.A OG1 ALA 30.A O no hydrogen 3.548 N/A GLY 34.A N ALA 30.A O no hydrogen 3.060 N/A THR 36.A OG1 ASP 38.A O no hydrogen 2.554 N/A LYS 39.A N ASP 38.A OD1 no hydrogen 3.012 N/A PHE 42.A N GLN 133.A O no hydrogen 2.825 N/A ILE 44.A N PHE 135.A O no hydrogen 2.734 N/A TYR 45.A N SER 49.A OG no hydrogen 2.851 N/A ASP 46.A N SER 49.A OG no hydrogen 2.782 N/A SER 49.A N ASP 46.A OD1 no hydrogen 2.671 N/A SER 49.A OG ASP 46.A O no hydrogen 2.907 N/A SER 49.A OG ASP 46.A OD1 no hydrogen 2.672 N/A LEU 50.A N ASP 46.A O no hydrogen 2.869 N/A MET 51.A N MET 47.A O no hydrogen 3.052 N/A MET 52.A N ASN 48.A O no hydrogen 3.124 N/A GLY 53.A N LEU 50.A O no hydrogen 2.978 N/A LYS 56.A NZ LEU 256.A O no hydrogen 3.317 N/A GLU 64.A N GLN 61.A O no hydrogen 2.697 N/A VAL 65.A N SER 62.A O no hydrogen 3.377 N/A ARG 68.A N GLU 64.A O no hydrogen 3.010 N/A ARG 68.A NH1 GLU 60.A OE2 no hydrogen 2.739 N/A ILE 69.A N VAL 65.A O no hydrogen 3.082 N/A PHE 70.A N ALA 66.A O no hydrogen 2.948 N/A GLN 71.A N ILE 67.A O no hydrogen 2.897 N/A GLY 72.A N ARG 68.A O no hydrogen 3.036 N/A CYS 73.A N ILE 69.A O no hydrogen 2.844 N/A CYS 73.A SG ILE 69.A O no hydrogen 3.830 N/A CYS 73.A SG PHE 70.A O no hydrogen 3.338 N/A GLN 74.A N PHE 70.A O no hydrogen 3.210 N/A GLN 74.A NE2 PHE 70.A O no hydrogen 2.821 N/A PHE 75.A N GLN 71.A O no hydrogen 2.902 N/A ARG 76.A N GLY 72.A O no hydrogen 3.057 N/A ARG 76.A NH1 GLU 259.A OE1 no hydrogen 2.715 N/A ARG 76.A NH1 ASP 263.A OD1 no hydrogen 3.013 N/A ARG 76.A NH2 GLU 259.A OE1 no hydrogen 3.318 N/A ARG 76.A NH2 GLU 259.A OE2 no hydrogen 3.060 N/A SER 77.A N GLN 74.A O no hydrogen 3.160 N/A SER 77.A OG GLN 74.A O no hydrogen 2.598 N/A VAL 78.A N PHE 75.A O no hydrogen 3.314 N/A VAL 81.A N SER 77.A O no hydrogen 2.980 N/A GLN 82.A N VAL 78.A O no hydrogen 2.893 N/A GLU 83.A N GLU 79.A O no hydrogen 2.978 N/A ILE 84.A N ALA 80.A O no hydrogen 2.915 N/A THR 85.A N VAL 81.A O no hydrogen 2.939 N/A THR 85.A OG1 VAL 81.A O no hydrogen 2.790 N/A GLU 86.A N GLN 82.A O no hydrogen 2.888 N/A TYR 87.A N GLU 83.A O no hydrogen 2.826 N/A TYR 87.A OH ALA 173.A O no hydrogen 2.662 N/A ALA 88.A N ILE 84.A O no hydrogen 2.858 N/A LYS 89.A N THR 85.A O no hydrogen 3.270 N/A LYS 89.A N GLU 86.A O no hydrogen 3.283 N/A LYS 89.A NZ GLU 86.A OE2 no hydrogen 3.110 N/A SER 90.A N TYR 87.A O no hydrogen 2.966 N/A SER 90.A OG SER 16.A OG no hydrogen 2.272 N/A SER 90.A OG TYR 87.A O no hydrogen 2.650 N/A ILE 91.A N ALA 88.A O no hydrogen 3.154 N/A PHE 94.A N ILE 91.A O no hydrogen 2.918 N/A LEU 97.A N PHE 94.A O no hydrogen 2.919 N/A ASP 101.A N ASP 98.A O no hydrogen 2.592 N/A GLN 102.A N ASP 98.A O no hydrogen 3.196 N/A GLN 102.A NE2 LEU 97.A O no hydrogen 2.780 N/A VAL 103.A N LEU 99.A O no hydrogen 3.320 N/A THR 104.A N ASN 100.A O no hydrogen 3.173 N/A THR 104.A OG1 ASN 100.A O no hydrogen 2.599 N/A LEU 105.A N ASP 101.A O no hydrogen 2.982 N/A LEU 106.A N GLN 102.A O no hydrogen 3.080 N/A LYS 107.A N VAL 103.A O no hydrogen 2.913 N/A TYR 108.A N THR 104.A O no hydrogen 3.178 N/A GLY 109.A N LEU 105.A O no hydrogen 2.937 N/A VAL 110.A N LEU 106.A O no hydrogen 2.879 N/A HIS 111.A ND1 TYR 265.A OH no hydrogen 2.779 N/A ILE 113.A N GLY 109.A O no hydrogen 3.043 N/A ILE 114.A N VAL 110.A O no hydrogen 3.006 N/A TYR 115.A N HIS 111.A O no hydrogen 3.380 N/A TYR 115.A OH TYR 265.A O no hydrogen 2.619 N/A THR 116.A N GLU 112.A O no hydrogen 3.304 N/A THR 116.A OG1 GLU 112.A O no hydrogen 3.501 N/A MET 117.A N ILE 113.A O no hydrogen 2.931 N/A LEU 118.A N ILE 114.A O no hydrogen 2.939 N/A ALA 119.A N TYR 115.A O no hydrogen 3.020 N/A SER 120.A N THR 116.A O no hydrogen 3.456 N/A LEU 121.A N LEU 118.A O no hydrogen 2.915 N/A MET 122.A N ALA 119.A O no hydrogen 3.050 N/A ASN 123.A N GLY 126.A O no hydrogen 2.979 N/A ASP 125.A N ASN 123.A OD1 no hydrogen 2.781 N/A GLY 126.A N ASN 123.A O no hydrogen 3.314 N/A GLY 126.A N ASN 123.A OD1 no hydrogen 3.047 N/A VAL 127.A N MET 136.A O no hydrogen 2.973 N/A LEU 128.A N LEU 121.A O no hydrogen 3.050 N/A ILE 129.A N GLY 134.A O no hydrogen 2.777 N/A SER 130.A N ASP 263.A OD2 no hydrogen 3.121 N/A SER 130.A OG ASP 55.A O no hydrogen 3.365 N/A GLN 133.A N SER 130.A O no hydrogen 3.171 N/A GLY 134.A N ILE 129.A O no hydrogen 3.094 N/A PHE 135.A N PHE 42.A O no hydrogen 2.778 N/A MET 136.A N VAL 127.A O no hydrogen 2.966 N/A THR 137.A N ILE 44.A O no hydrogen 3.065 N/A ARG 138.A N ASP 125.A O no hydrogen 2.707 N/A ARG 138.A NE GLU 153.A OE1 no hydrogen 3.028 N/A ARG 138.A NE GLU 153.A OE2 no hydrogen 3.127 N/A ARG 138.A NH1 LYS 124.A O no hydrogen 3.384 N/A ARG 138.A NH2 GLU 153.A OE2 no hydrogen 2.536 N/A PHE 140.A N THR 137.A OG1 no hydrogen 3.123 N/A LEU 141.A N THR 137.A O no hydrogen 3.131 N/A LYS 142.A N ARG 138.A O no hydrogen 2.967 N/A SER 143.A N PHE 140.A O no hydrogen 3.053 N/A SER 143.A OG PHE 140.A O no hydrogen 2.632 N/A LEU 144.A N LEU 141.A O no hydrogen 3.383 N/A PHE 148.A N ARG 145.A O no hydrogen 2.809 N/A GLY 149.A N ARG 145.A O no hydrogen 3.403 N/A ASP 150.A N PRO 147.A O no hydrogen 3.281 N/A PHE 151.A N PHE 148.A O no hydrogen 3.290 N/A LYS 155.A NZ TYR 115.A OH no hydrogen 3.293 N/A LYS 155.A NZ TYR 265.A O no hydrogen 3.025 N/A LYS 155.A NZ TYR 265.A OXT no hydrogen 2.546 N/A PHE 156.A N MET 152.A O no hydrogen 2.901 N/A GLU 157.A N GLU 153.A O no hydrogen 2.955 N/A PHE 158.A N PRO 154.A O no hydrogen 3.238 N/A ALA 159.A N LYS 155.A O no hydrogen 2.912 N/A VAL 160.A N PHE 156.A O no hydrogen 2.965 N/A LYS 161.A N GLU 157.A O no hydrogen 3.291 N/A PHE 162.A N PHE 158.A O no hydrogen 2.712 N/A ASN 163.A N ALA 159.A O no hydrogen 2.567 N/A ASN 163.A ND2 ALA 119.A O no hydrogen 2.979 N/A ALA 164.A N VAL 160.A O no hydrogen 3.077 N/A LEU 165.A N PHE 162.A O no hydrogen 3.053 N/A GLU 166.A N ASN 163.A O no hydrogen 2.996 N/A ASP 168.A N ASP 171.A OD2 no hydrogen 3.035 N/A SER 170.A OG ASP 168.A OD1 no hydrogen 2.459 N/A ASP 171.A N ASP 168.A OD1 no hydrogen 3.152 N/A LEU 172.A N ASP 168.A O no hydrogen 2.896 N/A ALA 173.A N ASP 169.A O no hydrogen 3.208 N/A ILE 174.A N ASP 171.A O no hydrogen 3.100 N/A PHE 175.A N ASP 171.A O no hydrogen 3.087 N/A ILE 176.A N LEU 172.A O no hydrogen 2.926 N/A ALA 177.A N ALA 173.A O no hydrogen 3.058 N/A VAL 178.A N ILE 174.A O no hydrogen 2.879 N/A ILE 179.A N PHE 175.A O no hydrogen 3.152 N/A ILE 180.A N ILE 176.A O no hydrogen 3.260 N/A LEU 181.A N ALA 177.A O no hydrogen 3.145 N/A SER 182.A OG ILE 179.A O no hydrogen 2.364 N/A ARG 185.A NH1 GLU 112.A OE2 no hydrogen 3.093 N/A ARG 185.A NH2 GLU 112.A OE1 no hydrogen 2.966 N/A ARG 185.A NH2 ILE 179.A O no hydrogen 3.375 N/A LEU 189.A N ASP 101.A OD1 no hydrogen 2.951 N/A ASN 190.A N ASP 101.A OD2 no hydrogen 3.244 N/A LYS 192.A N ASN 190.A O no hydrogen 2.989 N/A LYS 192.A NZ ASP 196.A OD2 no hydrogen 3.156 N/A ASP 196.A N LYS 192.A O no hydrogen 2.993 N/A ILE 197.A N PRO 193.A O no hydrogen 3.220 N/A GLN 198.A N ILE 194.A O no hydrogen 3.076 N/A GLN 198.A NE2 VAL 178.A O no hydrogen 3.092 N/A ASP 199.A N GLU 195.A O no hydrogen 3.093 N/A ASN 200.A N ASP 196.A O no hydrogen 3.396 N/A LEU 201.A N ILE 197.A O no hydrogen 2.819 N/A LEU 202.A N GLN 198.A O no hydrogen 2.628 N/A GLN 203.A N ASP 199.A O no hydrogen 3.102 N/A ALA 204.A N ASN 200.A O no hydrogen 3.145 N/A LEU 205.A N LEU 201.A O no hydrogen 2.925 N/A GLU 206.A N LEU 202.A O no hydrogen 2.818 N/A LEU 207.A N GLN 203.A O no hydrogen 2.951 N/A GLN 208.A N ALA 204.A O no hydrogen 2.787 N/A GLN 208.A NE2 ASP 171.A OD1 no hydrogen 2.801 N/A LEU 209.A N LEU 205.A O no hydrogen 3.049 N/A LYS 210.A N GLU 206.A O no hydrogen 3.301 N/A LEU 211.A N LEU 207.A O no hydrogen 2.963 N/A ASN 212.A N GLN 208.A O no hydrogen 2.904 N/A ASN 212.A ND2 ASP 168.A OD2 no hydrogen 2.796 N/A ASN 212.A ND2 ASP 171.A OD1 no hydrogen 3.075 N/A ASN 212.A ND2 ASP 171.A OD2 no hydrogen 3.442 N/A HIS 213.A N LEU 209.A O no hydrogen 2.916 N/A HIS 213.A NE2 ASP 171.A OD2 no hydrogen 2.691 N/A GLU 215.A N GLU 215.A OE1 no hydrogen 2.632 N/A SER 216.A N HIS 213.A O no hydrogen 3.059 N/A LYS 222.A N GLN 218.A O no hydrogen 2.700 N/A LYS 222.A NZ SER 217.A O no hydrogen 2.981 N/A LEU 223.A N LEU 219.A O no hydrogen 2.816 N/A LEU 224.A N PHE 220.A O no hydrogen 2.937 N/A GLN 225.A N ALA 221.A O no hydrogen 2.954 N/A LYS 226.A N LYS 222.A O no hydrogen 3.309 N/A LYS 226.A N LEU 223.A O no hydrogen 3.069 N/A LYS 226.A NZ ASP 229.A OD2 no hydrogen 3.550 N/A MET 227.A N LEU 224.A O no hydrogen 3.217 N/A ASP 229.A N GLN 225.A O no hydrogen 3.224 N/A LEU 230.A N LYS 226.A O no hydrogen 2.778 N/A ARG 231.A N MET 227.A O no hydrogen 3.145 N/A ARG 231.A NH1 ASP 184.A OD1 no hydrogen 3.173 N/A ARG 231.A NH2 ASP 184.A OD1 no hydrogen 3.018 N/A GLN 232.A N THR 228.A O no hydrogen 3.062 N/A ILE 233.A N ASP 229.A O no hydrogen 2.994 N/A VAL 234.A N LEU 230.A O no hydrogen 3.185 N/A THR 235.A N ARG 231.A O no hydrogen 2.796 N/A THR 235.A OG1 ARG 231.A O no hydrogen 3.058 N/A THR 235.A OG1 GLN 232.A O no hydrogen 3.279 N/A GLU 236.A N GLN 232.A O no hydrogen 2.690 N/A HIS 237.A N VAL 234.A O no hydrogen 2.948 N/A VAL 238.A N THR 235.A O no hydrogen 3.010 N/A LEU 240.A N GLU 236.A O no hydrogen 3.248 N/A LEU 241.A N HIS 237.A O no hydrogen 3.178 N/A GLN 242.A N VAL 238.A O no hydrogen 3.284 N/A VAL 243.A N GLN 239.A O no hydrogen 3.096 N/A ILE 244.A N LEU 240.A O no hydrogen 3.157 N/A LYS 245.A N LEU 241.A O no hydrogen 3.368 N/A THR 247.A OG1 VAL 243.A O no hydrogen 2.605 N/A THR 249.A N THR 247.A O no hydrogen 2.901 N/A LEU 256.A N HIS 254.A ND1 no hydrogen 3.448 N/A GLN 258.A N HIS 254.A O no hydrogen 3.095 N/A GLN 258.A NE2 LEU 253.A O no hydrogen 2.899 N/A GLU 259.A N PRO 255.A O no hydrogen 2.852 N/A ILE 260.A N LEU 256.A O no hydrogen 3.077 N/A TYR 261.A N LEU 257.A O no hydrogen 2.893 N/A LYS 262.A N GLN 258.A O no hydrogen 3.252 N/A ASP 263.A N ILE 260.A O no hydrogen 3.148 N/A LEU 264.A N TYR 261.A O no hydrogen 2.977 N/A TYR 265.A OH HIS 111.A ND1 no hydrogen 2.779 N/A